Chem
J-GLOBAL ID:201007095929488913   Nikkaji number:J2.820.987H

3-(Trifluoromethyl)-4-cyanophenyl isocyanate

4-イソシアナト-2-(トリフルオロメチル)ベンゾニトリル
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C9H3F3N2O
Molecular formula furigana: C9-H3-F3-N2-O
Molecular weight: 212.131
InChI: InChI=1S/C9H3F3N2O/c10-9(11,12)8-3-7(14-5-15)2-1-6(8)4-13/h1-3H
InChI key: BQRKAMKMDZEEES-UHFFFAOYSA-N
SMILES: FC(F)(F)c1cc(ccc1C#N)N=C=O
Systematic name  (3):
  • 3-(トリフルオロメチル)-4-シアノフェニルイソシアナート
  • 4-イソシアナト-2-(トリフルオロメチル)ベンゾニトリル
  • 4-isocyanato-2-(trifluoromethyl)benzonitrile
Other name (1):
  • 3-(Trifluoromethyl)-4-cyanophenyl isocyanate
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